@<TRIPOS>MOLECULE
71586904
35 35 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     0.2967     0.2878    -0.0469	N.2	1	noname	-0.2641
2	C1     2.5680    -0.6642    -0.2631	C.3	1	noname	0.0482
3	C2    -2.0591     1.0265     0.0813	C.3	1	noname	0.0482
4	C3     1.6675     0.4267     0.0982	C.2	1	noname	-0.0003
5	C4    -0.6314     1.2666     0.2693	C.2	1	noname	-0.0003
6	C5     2.9722    -0.5265    -1.7324	C.3	1	noname	-0.0546
7	C6     1.8576    -2.0028    -0.0529	C.3	1	noname	-0.0546
8	C7     3.8181    -0.6063     0.6172	C.3	1	noname	-0.0546
9	C8    -2.3365     0.7293    -1.3937	C.3	1	noname	-0.0546
10	C9    -2.4916    -0.1691     0.9325	C.3	1	noname	-0.0546
11	C10    -2.8456     2.2675     0.5082	C.3	1	noname	-0.0546
12	C11     2.1856     1.6637     0.6104	C.2	1	noname	-0.0401
13	C12    -0.1624     2.5216     0.7852	C.2	1	noname	-0.0401
14	C13     1.2490     2.6922     0.9453	C.2	1	noname	-0.0460
15	H1     4.4904    -1.4208     0.3475	H	1	noname	0.0240
16	H2     3.5302    -0.7044     1.6639	H	1	noname	0.0240
17	H3     4.3242     0.3473     0.4674	H	1	noname	0.0240
18	H4     2.5300    -2.8173    -0.3226	H	1	noname	0.0240
19	H5     0.9671    -2.0440    -0.6800	H	1	noname	0.0240
20	H6     1.5697    -2.1009     0.9938	H	1	noname	0.0240
21	H7     3.6445    -1.3409    -2.0021	H	1	noname	0.0240
22	H8     2.0816    -0.5677    -2.3595	H	1	noname	0.0240
23	H9     3.4783     0.4272    -1.8822	H	1	noname	0.0240
24	H10    -3.4024     0.5500    -1.5340	H	1	noname	0.0240
25	H11    -3.5575    -0.3484     0.7922	H	1	noname	0.0240
26	H12    -2.0284     1.5811    -2.0001	H	1	noname	0.0240
27	H13    -1.7762    -0.1548    -1.6978	H	1	noname	0.0240
28	H14    -2.2940     0.0426     1.9833	H	1	noname	0.0240
29	H15    -1.9313    -1.0533     0.6284	H	1	noname	0.0240
30	H16    -3.9116     2.0882     0.3679	H	1	noname	0.0240
31	H17    -2.6480     2.4792     1.5591	H	1	noname	0.0240
32	H18    -2.5375     3.1192    -0.0981	H	1	noname	0.0240
33	H19     3.1884     1.8047     0.7318	H	1	noname	0.0641
34	H20    -0.8142     3.2671     1.0298	H	1	noname	0.0641
35	H21     1.5997     3.5776     1.3106	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	4	2
2	1	5	1
3	2	4	1
4	2	6	1
5	2	7	1
6	2	8	1
7	3	5	1
8	3	9	1
9	3	10	1
10	3	11	1
11	4	12	1
12	5	13	2
13	6	21	1
14	6	22	1
15	6	23	1
16	7	18	1
17	7	19	1
18	7	20	1
19	8	15	1
20	8	16	1
21	8	17	1
22	9	24	1
23	9	26	1
24	9	27	1
25	10	25	1
26	10	28	1
27	10	29	1
28	11	30	1
29	11	31	1
30	11	32	1
31	12	14	2
32	12	33	1
33	13	14	1
34	13	34	1
35	14	35	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1